(3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone

C17H18O4 — CID 114965510

IUPAC(3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone
SMILESCOc1cc(OC)cc(C(=O)c2ccc(OC)cc2C)c1
InChIInChI=1S/C17H18O4/c1-11-7-13(19-2)5-6-16(11)17(18)12-8-14(20-3)10-15(9-12)21-4/h5-10H,1-4H3
InChIKeyFBFIHPVCYFIILF-UHFFFAOYSA-N
MW286.33 g/mol
LogP3.25
Rot. Bonds5

About (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone

(3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone (PubChem CID 114965510) has the molecular formula C17H18O4 and a molecular weight of 286.33 g/mol. Its IUPAC name is (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone.

Molecular Properties

Compound Name(3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone
PubChem CID114965510
Molecular FormulaC17H18O4
Molecular Weight286.33 g/mol
Exact Mass286.12
IUPAC Name(3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone
SMILESCOc1cc(OC)cc(C(=O)c2ccc(OC)cc2C)c1
InChIInChI=1S/C17H18O4/c1-11-7-13(19-2)5-6-16(11)17(18)12-8-14(20-3)10-15(9-12)21-4/h5-10H,1-4H3
InChIKeyFBFIHPVCYFIILF-UHFFFAOYSA-N
XLogP3.25
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

furan-3-yl-(4-methoxy-2-methylphenyl)methanone
CID 65313451
(2-fluoro-4-methoxyphenyl)-(4-methylphenyl)methanone
CID 43561161
4-methoxy-2-methyl-1-[1,2,2-tris(4-methoxy-2-methylphenyl)ethenyl]benzene
CID 102177256
(3,5-dimethoxyphenyl)-(4-iodophenyl)methanone
CID 24723154
(2-bromo-4-methoxyphenyl)-(4-bromophenyl)methanone
CID 60786107
(2-bromo-3-methylphenyl)-(3,5-dimethoxyphenyl)methanone
CID 107984562
(4-bromo-3-methylphenyl)-(2,4-dimethoxyphenyl)methanone
CID 114971196
4-(2-hydroxy-4-methoxybenzoyl)benzoic acid
CID 22162022
(3,5-dimethoxyphenyl)-(2-methylfuran-3-yl)methanone
CID 104789248
(2-fluoro-4-methoxyphenyl)-(4-fluorophenyl)methanone
CID 22475212
(2-chloro-4-methoxyphenyl)-(3-chloro-4-methylphenyl)methanone
CID 55196391
(2-fluoro-5-methoxyphenyl)-(4-methoxyphenyl)methanone
CID 102282476

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone?
The IUPAC name of (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone (CID 114965510) is (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone.
What is the SMILES notation for (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone?
The canonical SMILES for (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone is COc1cc(OC)cc(C(=O)c2ccc(OC)cc2C)c1.
What is the InChIKey of (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone?
The InChIKey is FBFIHPVCYFIILF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O4/c1-11-7-13(19-2)5-6-16(11)17(18)12-8-14(20-3)10-15(9-12)21-4/h5-10H,1-4H3.
What are the key properties of (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone?
(3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone has a molecular weight of 286.33 g/mol, XLogP of 3.25, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxyphenyl)-(4-methoxy-2-methylphenyl)methanone is sourced from PubChem (CID 114965510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).